orbital_charges     :real:2:4,6
  0.127381274718904E+001  0.963307496655511E+000  0.976989182108751E+000
  0.946212578456480E+000  0.127548561538363E+001  0.963531448592977E+000
  0.973381690490348E+000  0.943407424167925E+000  0.921629333855281E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.916639162262584E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.919370305980019E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.926233014857245E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
forces              :real:2:3,6
 -0.354618105391729E-001  0.108588788002443E-001 -0.792835537169568E-002
  0.442207001275896E-001 -0.924847068213641E-002 -0.544044848600447E-002
  0.114301622383051E-001 -0.151228245474504E-001  0.196052691700992E-002
  0.369635436385578E-002  0.514731352251371E-002  0.544437600821078E-002
 -0.110780684215791E-001 -0.881319775652532E-002  0.528374047597914E-002
 -0.128073377689985E-001  0.171783006633542E-001  0.680160456500295E-003
total_energy        :real:0:
 -0.489603137648254E+001
end_coords          :real:2:3,6
 -0.128243929851943E+001  0.120076212875887E-001 -0.702458582077099E-001
  0.120136687886973E+001 -0.352212798929305E-002 -0.772159235439844E-001
 -0.240923297894842E+001  0.179495536097774E+001 -0.167165916840087E+000
 -0.237889354158535E+001 -0.174027285137498E+001 -0.209048254075640E+000
  0.239190105468801E+001  0.171296289043598E+001 -0.229930992365849E+000
  0.230880286767582E+001 -0.181206807702347E+001 -0.956482352475437E-001
